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  1. Third-Parties
  2. MatprojStructure
  3. mp-505789

Entry Data

Table mix-ins: ['Structure', 'Thermodynamics'] Extra columns: ['energy_uncorrected', 'band_gap', 'is_gap_direct', 'is_magnetic', 'total_magnetization', 'is_theoretical']

Base Information:

  • Database Entry ID: mp-505789
  • Created at: Sept. 4, 2022, 2:40 p.m.
  • Last updated at: Nov. 28, 2021, 1:35 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 26
  • Number of elements: 3
  • Element list: ['Ce', 'Ni', 'P']
  • Chemical System: Ce-Ni-P
  • Density: 7.601222662607062
  • Atomic Density: 0.07301806273806206
  • Unit Cell Volume: 356.0762779104382
  • Molar Volume: 8.247467180282836
  • Full Formula: Ce4 Ni14 P8
  • Reduced Formula: Ce2Ni7P4
  • Formula Anonymous: A2B4C7
  • Spacegroup Number: 31
  • Spacegroup Symbol: Pmn2_1
  • Crystal System: orthorhombic
  • Pointgroup: mm2

Thermodynamics:

  • Final energy: -170.33497452
  • Final energy per atom: -6.551345173846154
  • Energy above hull: None
  • Is thermodynamically stable?: None
  • Decomposes to: None
  • Formation energy None
  • Formation energy per atom: None
Note: stabilities and hull energies are updated on a running schedule, so newer materials may have these fields blank.